ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012170
RECORD_TITLE: EICOSANE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: IIDA Y, DAISHIMA S, FAC. OF ENGINEERING, SEIKEI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: EICOSANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₀H₄₂
CH$EXACT_MASS: 282.32865
CH$SMILES: CCCCCCCCCCCCCCCCCCCC
CH$IUPAC: InChI=1S/C20H42/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3
CH$LINK: CAS 112-95-8
CH$LINK: INCHIKEY CBFCDTFDPHXCNY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1025227

AC$INSTRUMENT: FINNIGAN-MAT 4500
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 120 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE

PK$SPLASH: splash10-001i-0190000000-81b5d2ec93cf739de33d
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  57 2.79 28
  71 3.93 39
  85 5.16 52
  99 3.56 36
  113 3.16 32
  127 3.04 30
  141 2.95 30
  155 2.83 28
  169 2.86 29
  183 2.9 29
  197 2.9 29
  211 2.98 30
  225 3.3 33
  239 3.02 30
  253 3.83 38
  267 12.63 126
  268 2.55 26
  281 99.99 999
  282 21.23 212
  283 2.25 23
//